SCHEMBL14015979

SCHEMBL14015979

CC(=O)/C(=C\C=C\N1CCOCC1)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.48
▸ GAA P10253 2/20 0.48
▸ RECQL P46063 1/20 0.46
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ RAB9A P51151 4/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ HTT P42858 3/20 0.43
▸ MAPT P10636 6/20 0.43
▸ USP2 O75604 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ALOX12 P18054 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ HSP90AA1 P07900 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ FKBP1A P62942 1/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14135580 0.73 RECQL (0.45) ALDH1A1GAARECQLSMN1; SMN2RAB9A
SCHEMBL13856976 0.73 RECQL (0.45) ALDH1A1GAARECQLSMN1; SMN2RAB9A
SCHEMBL12268038 0.72 ALDH1A1 (0.70) ALDH1A1GAARECQLSMN1; SMN2RAB9A
SCHEMBL14015974 0.72 CYP3A4 (0.42) ALDH1A1RECQLSMN1; SMN2RAB9ANPC1
SCHEMBL14015978 0.72 NPC1 (0.43) ALDH1A1GAASMN1; SMN2RAB9ANPC1
SCHEMBL11878518 0.68 CYP3A4 (0.52) ALDH1A1RECQLMEN1KMT2AMAPK1
SCHEMBL11878522 0.68 CYP3A4 (0.52) ALDH1A1RECQLMEN1KMT2AMAPK1
SCHEMBL16116063 0.68 RECQL (0.58) ALDH1A1GAARECQLSMN1; SMN2RAB9A
SCHEMBL16116072 0.68 RECQL (0.58) ALDH1A1GAARECQLSMN1; SMN2RAB9A
SCHEMBL14015985 0.68 MEN1 (0.36) ALDH1A1GAASMN1; SMN2RAB9AMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080260661-A1 Aminobutadiene-Based Uv Screens FUJI PHOTO FILM B.V. 2008-10-23 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080260661-A1 Aminobutadiene-Based Uv Screens ALAD, AAAS, ALDH7A1 ALDH1A1 79/4885GAA 921/4885RECQL 131/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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